(4aS,10aR)-10a-methyl-7-nitro-3-propan-2-yl-2,4a-dihydro-1H-dibenzo-p-dioxin

Systemtic Name: (4aS,10aR)-10a-methyl-7-nitro-3-propan-2-yl-2,4a-dihydro-1H-dibenzo-p-dioxin Openeye Name: (4aS,10aR)-3-isopropyl-10a-methyl-7-nitro-2,4a-dihydro-1H-dibenzo-p-dioxin CAS Name: (4aS,10aR)-10a-methyl-7-nitro-3-propan-2-yl-2,4a-dihydro-1H-dibenzo-p-dioxin IUPAC Name: (4aS,10aR)-10a-methyl-7-nitro-3-propan-2-yl-2,4a-dihydro-1H-dibenzo-p-dioxin Traditional Name: (4aS,10aR)-3-isopropyl-10a-methyl-7-nitro-2,4a-dihydro-1H-dibenzo-p-dioxin Formula: C16H19NO4 MolecularWeight: 289.32636

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC2C(CC1)(OC3=C(O2)C=C(C=C3)[N+](=O)[O-])C

Isomeric SMILES

CC(C)C1=C[C@H]2[C@@](CC1)(OC3=C(O2)C=C(C=C3)[N+](=O)[O-])C

InChI

InChI=1S/C16H19NO4/c1-10(2)11-6-7-16(3)15(8-11)20-14-9-12(17(18)19)4-5-13(14)21-16/h4-5,8-10,15H,6-7H2,1-3H3/t15-,16+/m0/s1